Mrv1533006051505192D 40 41 0 0 0 0 999 V2000 10.1423 -12.0997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1423 -12.9247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8567 -13.3372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5712 -12.9247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5712 -12.0997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8567 -11.6872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2867 -11.6872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0012 -12.0997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7157 -11.6872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4301 -12.0997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1446 -11.6872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8591 -12.0997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5735 -11.6872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2880 -12.0997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0024 -11.6872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7169 -12.0997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4314 -11.6872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.1458 -12.0997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.8602 -11.6872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.5748 -12.0997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.2892 -11.6872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.0036 -12.0997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.7181 -11.6872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.4326 -12.0997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.1470 -11.6872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.8720 -12.0997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 26.5839 -11.6827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 26.5786 -10.8577 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.8536 -10.4452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.1693 -10.8622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.4464 -10.4432 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.0036 -12.9247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.1458 -12.9247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5735 -10.8622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7157 -10.8622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2865 -13.3376 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8567 -10.8628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4345 -11.6912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.8771 -12.9424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 27.2939 -12.0865 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 2 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 1 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 2 0 0 0 0 27 28 1 0 0 0 0 28 29 2 0 0 0 0 29 30 1 0 0 0 0 25 30 2 0 0 0 0 30 31 1 0 0 0 0 22 32 1 0 0 0 0 18 33 1 0 0 0 0 13 34 1 0 0 0 0 9 35 1 0 0 0 0 4 36 1 0 0 0 0 6 37 1 0 0 0 0 1 38 1 0 0 0 0 26 39 1 0 0 0 0 27 40 1 0 0 0 0 M END > NP0065653 > NP-MRD > C\C(\C=C\C=C(/C)\C=C\C1=C(C)C=CC(C)=C1C)=C/C=C/C=C(\C)/C=C/C=C(\C)/C=C/C1=C(C)C=CC(C)=C1C > InChI=1S/C40H48/c1-29(17-13-19-31(3)21-27-39-35(7)25-23-33(5)37(39)9)15-11-12-16-30(2)18-14-20-32(4)22-28-40-36(8)26-24-34(6)38(40)10/h11-28H,1-10H3/b12-11+,17-13+,18-14+,27-21+,28-22+,29-15+,30-16+,31-19+,32-20+ > ZCIHMQAPACOQHT-YSEOPJLNSA-N > C40H48 > 528.824 > 528.375601546 > 0 > 88 > 70.06307144605306 > 0 > 0 > 0 > 0 > 1,2,4-trimethyl-3-[(1E,3E,5E,7E,9E,11E,13E,15E,17E)-3,7,12,16-tetramethyl-18-(2,3,6-trimethylphenyl)octadeca-1,3,5,7,9,11,13,15,17-nonaen-1-yl]benzene > 9.16 > 12.584785660666668 > -7.49 > 0 > 2 > 0 > 0.0 > 191.43680000000012 > 10 > 0 > 1.70e-05 g/l > isorenieratene > 1 > NP0065653 > Isorenieratene $$$$